SCHEMBL17351817

SCHEMBL17351817

CCc1c(C)nc2c(C(=O)O)c(Cl)nn2c1O

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.33
NPSR1 Q6W5P4 3/20 0.33
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 5/20 0.33
TDP1 Q9NUW8 3/20 0.33
MAPT P10636 2/20 0.33
HSD17B10 Q99714 3/20 0.33
GAA P10253 2/20 0.33
TSHR P16473 1/20 0.33
HPGD P15428 1/20 0.32
RXRA P19793 2/20 0.32
NR4A2 P43354 2/20 0.32
POLB P06746 2/20 0.31
GLA P06280 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19668756 0.69 POLB (0.46) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL19436673 0.68 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL5198307 0.67 NPSR1 (0.47) KDM4ENPSR1ALDH1A1SMN1; SMN2MEN1
SCHEMBL29274960 0.67 ALDH1A1 (0.39) KDM4ENPSR1ALDH1A1SMN1; SMN2MEN1
SCHEMBL29231745 0.67 MAPT (0.43) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL21775850 0.65 KDM4E (0.41) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL17874231 0.64 P2RX3 (0.41) ALDH1A1L3MBTL1HSD17B10RXRANR4A2
SCHEMBL29222692 0.64 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL2805456 0.64 ADORA3 (0.45) KDM4ENPSR1ALDH1A1SMN1; SMN2MEN1
SCHEMBL461266 0.63 KDM4E (0.41) KDM4ENPSR1ALDH1A1SMN1; SMN2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9963451-B2 Fused ring pyrimidine compound and pest control agent containing the same MITSUI CHEMICALS AGRO, INC. (JP) 2018-05-08 US disclosed
US-20150368249-A1 FUSED RING PYRIMIDINE COMPOUND AND PEST CONTROL AGENT CONTAINING THE SAME MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2015-12-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150368249-A1 FUSED RING PYRIMIDINE COMPOUND AND PEST CONTROL AGENT CONTAINING THE SAME CBR3, HRH2, HRH4 KDM4E 1972/4885NPSR1 222/4885ALDH1A1 3675/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.